CS-0311290

tert-Butyl 3-((tert-butoxycarbonyl)amino)-3-formylazepane-1-carboxylate

Manufacturer: ChemScene

CAS Number: 2600792-68-3

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Purity

98%

MDL No

None

Storage

Sealed in dry,2-8℃

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₁₇H₃₀N₂O₅

Molecular Weight

342.43

Synonyms

1H-Azepine-1-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-formylhexahydro-, 1,1-dimethylethyl ester

SMILES

O=C(N1CC(C=O)(NC(OC(C)(C)C)=O)CCCC1)OC(C)(C)C

Tpsa

84.94

Logp

2.8698

H Acceptors

5

H Donors

1

Rotatable Bonds

2

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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ChemScene

CS-0311290

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₇H₃₀N₂O₅

Molecular Weight:
342.43

Synonyms:
1H-Azepine-1-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-formylhexahydro-, 1,1-dimethylethyl ester

SMILES:
O=C(N1CC(C=O)(NC(OC(C)(C)C)=O)CCCC1)OC(C)(C)C

Tpsa:
84.94

Logp:
2.8698

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-0311292

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₇H₁₉O₈P

Molecular Weight:
382.30

Synonyms:
4H-Pyran-2-carboxylic acid, 6-[(dimethoxyphosphinyl)methyl]-4-oxo-3-(phenylmethoxy)-, methyl ester

SMILES:
O=C(C1=C(OCC2=CC=CC=C2)C(C=C(CP(OC)(OC)=O)O1)=O)OC

Tpsa:
101.27

Logp:
2.9913

H Acceptors:
8

H Donors:
0

Rotatable Bonds:
8

Img

ChemScene

CS-0311294

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₁H₁₁FO₃

Molecular Weight:
210.20

Synonyms:
None

SMILES:
O=C(C1(C)OC2=CC(F)=CC=C2C1)OC

Tpsa:
35.53

Logp:
1.6923

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
1

Img

ChemScene

CS-0311295

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Purity:
95%

MDL No:
MFCD20661020

Storage:
4°C

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₈H₇BO₄

Molecular Weight:
177.95

Synonyms:
None

SMILES:
O=C(C1=C(B(O)OC2)C2=CC=C1)O

Tpsa:
66.76

Logp:
-0.3975

H Acceptors:
3

H Donors:
2

Rotatable Bonds:
1